9IXN

Crystal structure of OXA-10

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 5C (4A)
Synchrotron site	PAL/PLS
Beamline	5C (4A)
Temperature [K]	100
Detector technology	CCD
Collection date	2022-10-20
Detector	ADSC QUANTUM 315r
Wavelength(s)	1.0000
Spacegroup name	P 21 21 21
Unit cell lengths	49.050, 103.640, 126.660
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	28.240 - 1.920
R-factor	0.18239
Rwork	0.181
R-free	0.21346
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1fof
RMSD bond length	0.009
RMSD bond angle	1.584
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	HKL-3000
Refinement software	REFMAC (5.8.0403)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	28.240	1.989
High resolution limit [Å]	1.920	1.920
Rmerge	0.125
Rmeas	0.130
Rpim	0.035	0.386
Number of reflections	50131	4894
<I/σ(I)>	16.16
Completeness [%]	99.8
Redundancy	13.4
CC(1/2)	0.999

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		288	20% PEG 3350, 0.2 M Sodium formate, 0.1 M Tris-HCl pH 7.0